6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one

C15H20N4O — CID 170778274

IUPAC6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one
SMILESNCCCC1CC(n2cc(-c3cccc(=O)[nH]3)cn2)C1
InChIInChI=1S/C15H20N4O/c16-6-2-3-11-7-13(8-11)19-10-12(9-17-19)14-4-1-5-15(20)18-14/h1,4-5,9-11,13H,2-3,6-8,16H2,(H,18,20)
InChIKeyXSZGJWSFBLXMNM-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.93
Rot. Bonds5

About 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one

6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one (PubChem CID 170778274) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one
PubChem CID170778274
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one
SMILESNCCCC1CC(n2cc(-c3cccc(=O)[nH]3)cn2)C1
InChIInChI=1S/C15H20N4O/c16-6-2-3-11-7-13(8-11)19-10-12(9-17-19)14-4-1-5-15(20)18-14/h1,4-5,9-11,13H,2-3,6-8,16H2,(H,18,20)
InChIKeyXSZGJWSFBLXMNM-UHFFFAOYSA-N
XLogP1.93
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one?
The IUPAC name of 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one (CID 170778274) is 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one?
The canonical SMILES for 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one is NCCCC1CC(n2cc(-c3cccc(=O)[nH]3)cn2)C1.
What is the InChIKey of 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one?
The InChIKey is XSZGJWSFBLXMNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-6-2-3-11-7-13(8-11)19-10-12(9-17-19)14-4-1-5-15(20)18-14/h1,4-5,9-11,13H,2-3,6-8,16H2,(H,18,20).
What are the key properties of 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one?
6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one has a molecular weight of 272.35 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-[3-(3-aminopropyl)cyclobutyl]pyrazol-4-yl]-1H-pyridin-2-one is sourced from PubChem (CID 170778274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).